METHYL-6-(4-[11-(4-[4-(METHOXYCARBONYLBUTYL)-PHENYL]-UNDECYL)-PHENYL]-HEXANOATE

SpectraBase Compound ID	HdwscNqKJMC
InChI	InChI=1S/C36H54O4/c1-39-35(37)21-14-10-13-19-33-25-23-31(24-26-33)17-11-8-6-4-3-5-7-9-12-18-32-27-29-34(30-28-32)20-15-16-22-36(38)40-2/h23-30H,3-22H2,1-2H3
InChIKey	OQEBLUICMKBBNK-UHFFFAOYSA-N Google Search
Mol Weight	550.8 g/mol
Molecular Formula	C36H54O4
Exact Mass	550.40221 g/mol

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SpectraBase Spectrum ID	4bf5sNfyAEO
Name	6-[4-[11-[4-(5-keto-5-methoxy-pentyl)phenyl]undecyl]phenyl]hexanoic acid methyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C36H54O4
InChI	InChI=1S/C36H54O4/c1-39-35(37)21-14-10-13-19-33-25-23-31(24-26-33)17-11-8-6-4-3-5-7-9-12-18-32-27-29-34(30-28-32)20-15-16-22-36(38)40-2/h23-30H,3-22H2,1-2H3
InChIKey	OQEBLUICMKBBNK-UHFFFAOYSA-N
Molecular Weight	550.824 g/mol
SMILES	C(=O)(OC)CCCCCc1ccc(cc1)CCCCCCCCCCCc1ccc(cc1)CCCCC(=O)OC
SPLASH	splash10-0159-0600090000-3144b99fc99e8a145b93
Source of Spectrum	KC-0-1149-38
Synonyms	6-[4-[11-[4-(5-methoxy-5-oxopentyl)phenyl]undecyl]phenyl]hexanoic acid methyl ester Methyl 6-[4-[11-[4-(5-methoxy-5-oxidanylidene-pentyl)phenyl]undecyl]phenyl]hexanoate Methyl 6-[4-[11-[4-(5-methoxy-5-oxo-pentyl)phenyl]undecyl]phenyl]hexanoate
Wiley ID	785641